SCHEMBL741264

SCHEMBL741264

CC(C)(C)OC(=O)NCCN1CCc2nc(C(=O)C3(N)CCCCC3NC(=O)c3cc4cc(Cl)ccc4[nH]3)sc2C1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.53
F2 P00734 4/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL740894 0.91 F10 (0.56) F10F2
Hydrochloric Acid SCHEMBL740601 0.89 F10 (0.55) F10F2
SCHEMBL742968 0.88 F10 (0.54) F10F2
Hydrochloric Acid SCHEMBL742600 0.88 F10 (0.58) F10F2
SCHEMBL4089850 0.87 F10 (0.71) F10F2
SCHEMBL4089845 0.87 F10 (0.71) F10F2
SCHEMBL743656 0.84 F10 (0.56) F10F2
SCHEMBL742024 0.84 F10 (0.60) F10F2
Hydrochloric Acid SCHEMBL743926 0.83 F10 (0.61) F10F2
SCHEMBL744263 0.83 F10 (0.58) F10F2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2431370-B1 Monoacylated 1,2-diaminocycloalkanes DAIICHI SANKYO CO LTD (JP) 2013-06-19 EP disclosed
EP-2431370-A1 Monoacylated 1,2-diaminocycloalkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-03-21 EP disclosed
US-7935824-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-05-03 US disclosed